UCSF

ZINC19270294

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 14 Yes

Other Names:

MFCD09802455

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.09 -0.34 -48.33 4 4 1 60 200.306 4
Mid Mid (pH 6-8) 0.09 1.57 -38.75 4 4 1 60 200.306 4
Mid Mid (pH 6-8) 0.09 1.88 -107.09 5 4 2 61 201.314 4

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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